Physical Sciences and Mathematics Commons^™

Impurity Production And Transport In The Prototype Material Plasma Exposure Experiment, Clyde J. Beers

Doctoral Dissertations

The Prototype Material Plasma Exposure eXperiment (Proto-MPEX) is a linear pulse plasma device at Oak Ridge National Laboratory with the purpose of doing the research and development for the heating concepts on the planned full MPEX device. The goal of MPEX is to perform material studies at fusion relevant conditions. To understand the conditions at the material target for performing plasma-material interaction studies the ion temperature and density, the electron temperature and density, and the particle flux and fluence must be known. Impurities within Proto-MPEX can alter the desired conditions at the material target and need to be understood for …

Electroweak Interactions And Fundamental Symmetries In Light Nuclei With Short-Range Effective Field Theories, Zichao Yang

Doctoral Dissertations

Effective field theories(EFTs) are powerful tools to study nuclear systems that display separation of scales. In this dissertation, we present halo EFT results for the $\beta$-delayed proton emission from $^{11}$Be, and pionless EFT results for three-nucleon systems. Halo nuclei are simply described by a tightly bound core and loosely bound valence nucleons. Using the halo EFT, we calculate the rate of the rare decay $^{11}$Be, which is a well-known halo nucleus, into $^{10}\text{Be} + p +e^- + \bar{\nu}_e$. We assume a shallow $1/2 ^+$ resonance in the $^{10}$Be$-p$ system with an energy consistent with a recent experiment by Ayyad {\it …

Auto-Curation Of Large Evolving Image Datasets, Sara Mousavicheshmehkaboodi

Doctoral Dissertations

Large image collections are becoming common in many fields and offer tantalizing opportunities to transform how research, work, and education are conducted if the information and associated insights could be extracted from them. However, major obstacles to this vision exist. First, image datasets with associated metadata contain errors and need to be cleaned and organized to be easily explored and utilized. Second, such collections typically lack the necessary context or may have missing attributes that need to be recovered. Third, such datasets are domain-specific and require human expert involvement to make the right interpretation of the image content. Fourth, the …

Total Internal Reflection: Applications In Nonlinear Microscopy And Fluorescence Anisotropy, Brandon Colon

Doctoral Dissertations

As technology advances to harness new energies and to create new cures, the sophistication of analysis grows not only in depth but in efficiency. Total internal reflection (TIR) has been coupled to microscopy leveraging its unique optical phenomenon on a breadth of topics. In this dissertation, the work presented will show how TIR was applied in two different instrumental analyses to evaluate two unique and complex systems. The first project features TIR paired with the transient absorption microscopy (TAM), a nonlinear optical technique, to gauge solvent mixing and diffusion in microreactors. Microreactors gained acclaim for their ability to produce high …

Instrument Development For High Sensitivity Size Characterization Of Lipid Vesicles And Other Biological Macromolecules Via Taylor Dispersion Analysis, Meagan Moser

Doctoral Dissertations

Just as humans communicate with other humans, the cells in our bodies communicate with each other through various, often complex, mechanisms. Cell-to-cell transmission of small molecules, lipids, proteins, peptides, or nucleic acids can be mediated by extracellular lipid vesicles called exosomes. Exosomes have been found to play a role in the delivery of regulatory molecules from one cell to another, serving as a universal communication mechanism. Currently, there is an emerging focus on characterizing exosome communication dynamics. Understanding exosome mechanisms of cell-to-cell communication requires accurate measurements of the spatiotemporal and chemical dynamics of exosome secretion. No current analytical approach offers …

Search For New Physics In Rare Higgs Boson Decays With The Cms Detector At The Large Hadron Collider, Himal Acharya

Doctoral Dissertations

A new boson with a mass of 125 GeV was discovered at the large hadron collider (LHC) in July 2012. The properties of this particle are so far consistent with the standard model (SM) expectation. Differences in the Higgs boson decay rates and predicted by the SM might indicate the presence of new particles and forces between them. Particularly, rare exclusive decays of the Higgs boson are a promising laboratory to study physics beyond the standard model. Searches for decays of the Higgs boson into a Z boson and a J/ψ meson or into pairs of J/ψ or Υ mesons …

Application Of Single-Ion Conducting Polymer Electrolytes (Sicpes), Sheng Zhao

Doctoral Dissertations

Polymer electrolytes have been widely studied as a potential candidate for next generation batterie with improved safety and higher energy density. Especially, single-ion conducting polymer electrolytes (SICPEs) have attracted significant attention due to their almost unity lithium-ion transport number, which is believed to help suppress lithium dendrite growth and extend battery cycle life. However, there is still a long way to go before they can be practically applied in batteries, due to their relatively low ionic conductivity at ambient temperature. Therefore, the main goal of this work is to explore various methods that can improve the ionic conductivity of SICPEs …

A Connectivity Framework To Explore The Role Of Anthropogenic Activity And Climate On The Propagation Of Water And Sediment At The Catchment Scale, Christos Giannopoulos

Doctoral Dissertations

Anthropogenic disturbance in intensively managed landscapes (IMLs) has dramatically altered critical zone processes, resulting in fundamental changes in material fluxes. Mitigating the negative effects of anthropogenic disturbance and making informed decisions for optimal placement and assessment of best management practices (BMPs) requires fundamental understanding of how different practices affect the connectivity or lack thereof of governing transport processes and resulting material fluxes across different landscape compartments within the hillslope-channel continuum of IMLs. However, there are no models operating at the event timescale that can accurately predict material flux transport from the hillslope to the catchment scale capturing the spatial and …

Production Of Protactinium-229 Via Deuteron Irradiation Of Thorium-232, Naser Burahmah

Doctoral Dissertations

²²⁵Ac [Actinium-225] is a promising radionuclide for targeted alpha therapy of cancer. ²²⁹Pa can lead to the production of ²²⁹Th [Thorium-229] and ²²⁵Ac [Actinium-225]. Deuteron bombardment on natural thorium targets has been investigated to measure cross sections of protactinium isotopes. In this work, ²²⁹Pa [Protactinium-229] excitation function was measured via deuteron energies up to 50 MeV [Mega electron volt] of thin thorium foils. The irradiation took place at Lawrence Berkeley National Laboratory’s (LBNL) 88-Inch Cyclotron. The target processing and analysis were performed at Oak Ridge National Laboratory (ORNL). The target consisted of 4 thin foils …

Production And Adsorption Of Volatile Tellurium Hexafluoride, Stephanie H. Bruffey

Doctoral Dissertations

Research and development supporting the management of off-gases from nuclear fuel reprocessing has historically been focused on the off-gas streams that arise from aqueous reprocessing technology. With the advent of advanced reactor designs off-gas streams arising from advanced reprocessing methodology, such as that of FV [fluoride volatility] processing, also merit consideration. This work focuses on TeF₆ [tellurium hexafluoride], one of the most volatile radioactive compounds produced during FV, and investigates TeF₆ production, measurement, and abatement technologies.

To assist in on-line monitoring of TeF₆ by Fourier-transformed infrared spectroscopy, this work systematically used the ideal gas law and Beer’s …

Analytical Considerations And Methods For Comprehensive Analysis Of Bacterial Phospholipidomics Using Hilic-Ms/Ms, David Thomas Reeves

Doctoral Dissertations

Omics technologies have rapidly evolved over the last half century through vast improvements in efficient extraction methodologies, advances in instrumentation for data collection, and a wide assortment of informatics tools to help deconvolute sample data sets. However, there are still untapped pools of molecules that warrant further analytical attention. As the frontline defense of the cell against exterior influences, the phospholipid membrane is key in structure, defense, and signaling, but current omics studies are only just now catching up to the potential hidden within cellular lipid profiles. Examination of shifts in phospholipid speciation and character could provide researchers with a …

Exploring The Potential Of Ionothermal Syntheses For High-Performance Lithium-Ion Battery Anode Materials, Runming Tao

Doctoral Dissertations

Renewable energy storage systems are regarded as the solution to the environmental and energy crises caused by the burning of fossil fuels in vehicles. Unfortunately, owning to the limits to the electrochemical performance of the current anode materials, lithium-ion batteries [LIBs] are still lacking strength in the charging rate-capability and thereby cannot fulfill future application requirements in electrical vehicles [EVs].

Particularly, graphite with a high theoretical specific capacity of 372 mAh/g is unsuitable for EVs due to the safety concerns of passivating solid-electrolyte interphase [SEI] resulted from the low operation potential of 0.1 V versus Li/Li⁺. The other …

Ultrasound-Driven Fabrication Of Nanosized High-Entropy Materials For Heterogeneous Catalysis, Francis Uchenna Okejiri

Doctoral Dissertations

High-entropy materials (HEMs) have emerged as a new class of multi-principal-element materials with great technological prospects. As a unique class of concentrated solid-solution materials, HEMs, formed on the premise of incorporating five or more principal elements into a single crystalline phase, provide an excellent opportunity to access superior catalytic materials ‘hiding’ in the unexplored central regions of a multicomponent phase space of higher orders.

However, the fabrication of HEMs is energy-intensive, typically requiring extreme temperatures and/or pressures under which agglomeration of particles occurs with a commensurate decrease in surface area. For most catalytic applications, non-agglomerated particles with high surface areas …

Interfaces And Dynamics In Polymeric 3d Printing And Crystalline Polymer Blends, Stevenson C. Perryman

Doctoral Dissertations

This dissertation presents experimental work that provide a foundation to rationally improve fused filament fabrication (FFF) and immiscible blend compatibilization. Objects generated from additive manufacturing processes, such as FFF, have intrinsic structural weaknesses which include two project specific examples: structural anisotropy and irreversible thermal strain. Due to low adhesion between individual print layers that results in macroscopic defects, the mechanical strength of printed objects when force is applied perpendicular to the build orientation is drastically reduced. In the first dissertation chapter, we present a protocol to produce interlayer covalent bonds by depositing multi-amine additives between individual layers of a print …

Using Applied Field, Pressure, And Light To Control Magnetic States Of Materials, Amanda J. Clune

Doctoral Dissertations

Due to their low energy scales, flexible architectures, and unique exchange pathways, molecule-based multiferroics host a number of unique properties and phase transitions under external stimuli. In this dissertation, we reveal the magnetic- and pressure-driven transitions in [(CH₃)₂NH₂]Mn(HCOO)₃ and (NH₄)₂[FeCl₅(H₂O)], present a detailed investigation of these materials away from standard equilibrium phases, and develop rich two- and three-dimensional phase diagrams.

The first platform for exploring phase transitions is [(CH₃)₂NH₂]Mn(HCOO)₃. This type-I multiferroic contains Mn centers linked by …

Interdomain Route Leak Mitigation: A Pragmatic Approach, Benjamin Tyler Mcdaniel

Doctoral Dissertations

The Internet has grown to support many vital functions, but it is not administered by any central authority. Rather, the many smaller networks that make up the Internet - called Autonomous Systems (ASes) - independently manage their own distinct host address space and routing policy. Routers at the borders between ASes exchange information about how to reach remote IP prefixes with neighboring networks over the control plane with the Border Gateway Protocol (BGP). This inter-AS communication connects hosts across AS boundaries to build the illusion of one large, unified global network - the Internet. Unfortunately, BGP is a dated protocol …

Characterization Techniques And Cation Exchange Membrane For Non-Aqueous Redox Flow Battery, Kun Lou

Doctoral Dissertations

The motivation of this work comes from one of the major problems of emerging non-aqueous flow battery (NAFB) that a separator or membrane which facilitates conductivity and blocks redox species crossover does not exist. Although many aspects of principles can be mirrored from mature fuel cell and aqueous flow battery, it is found that some well-defined membrane properties in aqueous systems such as swelling, transport and interactions are different in non-aqueous solvents to some extent. However, the approach of this work does follow the way perfluorosulfonate ion exchange membrane (PFSA) facilitated development of fuel cell and aqueous flow battery in …

Stimuli-Responsive Polyelectrolytes: Thermosensitive Zwitterionic Polymers And Charged Shape-Changing Star Molecular Bottlebrushes, Evan M. Lewoczko

Doctoral Dissertations

This dissertation work investigated two classes of stimuli-responsive polyelectrolytes: thermosensitive zwitterionic poly(sulfobetaine methacrylate)s (PSBMAs) and charged shape-changing star molecular bottlebrushes (SMBs). While zwitterionic polymers are explored for numerous applications, their structure-solution behavior relationship was poorly understood. The first part of this dissertation focused on the effects of N-substituents of PSBMAs on their behavior in water. A series of PSBMAs were synthesized, with systematically changed N-substituents, including symmetric N-n-alkyl substituents of various lengths and asymmetric N-substituents comprising one methyl and either one cyclohexyl, phenyl or 2-hydroxyethyl group. The behavior of PSBMAs with symmetric N-substituents …

Fabrication Of Specialized Scintillators For Nuclear Security Applications, Cordell James Delzer

Doctoral Dissertations

Radiation detectors are important for a variety of fields including medical imaging, oil drilling, and nuclear security. Within nuclear security, they can serve a multitude of purposes whether that be imaging, localization, isotopic identification, or even just activity measurement. Even without directly seeing a nuclear material it is often able to notice their existence without a detector. Scintillators make up an important part of these detectors due to their large intrinsic efficiency, low cost, large volume, and relatively low upkeep. Due to the importance of the large number of purposes these scintillators may be used for, it can often be …

Neutron Star Structure From Electromagnetic And Gravitational Wave Observations, Mohammad Al-Mamun

Doctoral Dissertations

Neutron star (NS) research primarily relied on spectral observations before the first gravitational wave (GW) detection from the binary neutron star merger was done by the LIGO-VIRGO collaboration. The GW170817 merger event provided mass and tidal deformability Λ˜ constraints for neutron stars. This project used these constraints and associated them with the constraints made by the NS X-ray observations to construct neutron star models. Selective X-ray sources were used in this work, which showed reliable uncertainties from their previous uses. The mass-radius constraints from the electromagnetic (EM) observations were constructed from seven quiescent low-mass X-ray binaries (QLMXBs), three photospheric radius …

Extending Core-Collapse Supernova Simulations: From The Onset Of Explosion To Shock Breakout, Michael A. Sandoval

Doctoral Dissertations

A core-collapse supernova (CCSN) is the result of a massive star’s core collapsing due to the inability of electron degeneracy pressure to provide sufficient support against gravity. Currently, there is a disconnect between when most three-dimensional CCSN simulations end (seconds) and when the explosion would reach the surface of the star and become visible (hours to days). We present three-dimensional simulations of CCSNe using the FLASH code that follow the progression of the explosion to the stellar surface, starting from neutrino-radiation hydrodynamic simulations of the first seconds performed with the Chimera code. We consider a 9.6-M_⊙ zero-metallicity progenitor, starting …

Development Of Density-Functional Tight-Binding Methods For Chemical Energy Science, Quan Vuong

Doctoral Dissertations

Density-functional tight-binding (DFTB) method is an approximation to the popular first-principles density functional theory (DFT) method. Recently, DFTB has gained considerable visibility due to its inexpensive computational requirements that confer it the capability of sustaining long-timescale reactive molecular dynamics (MD) simulations while providing an explicit description of electronic structure at all time steps. This capability allows the description of bond formation and breaking processes, as well as charge polarization and charge transfer phenomena, with accuracy and transferability beyond comparable classical reactive force fields. It has thus been employed successfully in the simulation of many complex chemical processes. However, its applications …

Roughening Interfaces In Spatial Population Dynamics, Clarisa E. Castillo

Doctoral Dissertations

The spatial structure and geometry of biological systems can have a strong effect on that system’s evolutionary dynamics. In particular, spatially structured populations may invade one another, giving rise to invasion fronts that may exhibit qualitatively different evolutionary dynamics in different dimensions or geometric configurations. For examples of invasion fronts arising in nature, one might think of a thin layer of bacteria cells growing on a Petri dish, an animal species expanding into new territory, or a cancerous tumor growing into and competing with the surrounding healthy tissue. Perhaps the most well-studied class of invasion fronts in population genetics is …

A Study Of Systematic Uncertainties For A Photon-Like Low Energy Excess Search At Microboone, Gray Yarbrough

Doctoral Dissertations

The premise of this dissertation is the study of and reduction of systematic uncertainties in the MicroBooNE experiment at the Fermi National Accelerator Laboratory. MicroBooNE is a short-baseline oscillation experiment using the innovative liquid argon time projection chamber technology to study, with unprecedented detail, neutrino interactions. The primary goal of MicroBooNE is the investigation of the MiniBooNE low energy excess (LEE) of electron neutrino events, a result which raised fundamental questions on the existence of sterile neutrinos with broad implications to the field of particle physics. The principal study of this dissertation is a study of systematics as part of …

Planetary Processes Active And Ancient: Hollowing On Mercury, Ancient Crust Formation On Mars, And Identifying Mars-Analog Habitats., Michael Steven Phillips

Doctoral Dissertations

This dissertation comprises a thermophysical model that shows elemental sulfur may be involved in the potentially active processes that form enigmatic features called hollows on the Mercurian surface, a suite of remote sensing techniques that unveil anorthositic rocks in ancient martian crust, and deep learning to discover the spatial resolutions necessary to identify astrobiology targets in images of Mars analog landscapes.

On Mercury, hollows are high-reflectance, flat-floored depressions observed nearly globally. Hollows are thought to form via sublimation, or a “sublimation-like” process, but the identity of the sublimating phase is poorly constrained. To better understand which phase might be responsible …

Birds And Bioenergy: A Modeling Framework For Managed Landscapes At Multiple Spatial Scales, Jasmine Asha Kreig

Doctoral Dissertations

This dissertation examines the design and management of bioenergy landscapes at multiple spatial scales given numerous objectives. Objectives include biodiversity outcomes, biomass feedstock yields, and economic value.

Our study examined biodiversity metrics for 25 avian species in Iowa, including subsets of these species related to ecosystem services. We used our species distribution model (SDM) framework to determine the importance of predictors related to switchgrass production on species richness. We found that distance to water, mean diurnal temperature range, and herbicide application rate were the three most important predictors of biodiversity overall. We found that 76% of species responded positively to …

Collector Probe Measurements Of Sol Impurity Accumulation And The Implications Of Sol Flows On The Accumulation Amount, Shawn Zamperini

Doctoral Dissertations

A collector probe in its simplest form is a rod inserted into a plasma so that impurities are deposited onto it. These probes are then removed and analyzed to determine the deposition profile both along the length of probe and across the width of it. This dissertation covers a series of collector probes experiments and accompanying interpretive modelling all with the main goal of providing evidence for long-hypothesized near scrape-off layer (SOL) accumulation of impurities that can lead to efficient core contamination. The structure of this dissertation is as follows. A brief outline of fusion energy and why we need …

Coarse Proximity Spaces, Jeremy D. Siegert

Doctoral Dissertations

This work is meant to present the current general landscape of the theory of coarse proximity spaces. It is largely comprised of two parts that are heavily interrelated, the study of boundaries of coarse proximity spaces, and the dimension theory of coarse proximity spaces. Along the way a study of the relationships between coarse proximity spaces and other structures in coarse geometry are explored.

We begin in chapter 2 by going over the necessary preliminary definitions and concepts from the study of small scale proximity spaces as well as coarse geometry. We then quickly proceed to the introduction of coarse …

Physical Adsorption Of Linear Hydrocarbon Quadrupoles On Graphite And Mgo (100): Effects Of The Compatibility Of Surface And Molecular Symmetries, Andrew J. Pedersen

Doctoral Dissertations

The process of physical adsorption finds a practical role in wide-ranging fields from catalysis, to lubrication, and even optoelectronics. Furthermore, it provides a mechanism to probe the fundamental understanding of intermolecular forces and how symmetries can play a role in the behavior of a system. Linear quadrupoles preferentially adopt square-T configurations when confined in two dimensions. This would lead the system to adopt a four-fold symmetry in the molecular lattice.

Two archetypal surfaces often studied in physisorption research are MgO (100), which has a four-fold symmetry of alternating charges, and the basal plane of graphite, which has a six-fold symmetry …

Development Of Catalysts For The Ring-Opening Polymerization Of Cyclic Esters And The Coordination-Insertion Polymerization Of Olefins, Alicia Doerr

Doctoral Dissertations

Over the past few decades, interest in the design and synthesis of tailorable polymeric materials has grown due to the well documented correlation between structure, property, and function. However, in order to obtain polymers with desired microstructures, well controlled synthetic methods are needed. Therefore, the continued investigation of homogeneous, single-site polymerization catalysts is important to gain a deeper understanding of how systematic modifications of polymerization conditions, ligand scaffold, metal center identity, cocatalyst or activator identity, etc. affect the catalytic activity, selectivity, and/or polymer topology obtained when using these catalysts for the polymerization of a variety of monomers. This dissertation will …